N-(3,4-dihydronaphthalen-1-yl)acetamide

C12H13NO — CID 10176439

IUPACN-(3,4-dihydronaphthalen-1-yl)acetamide
SMILESCC(=O)NC1=CCCc2ccccc21
InChIInChI=1S/C12H13NO/c1-9(14)13-12-8-4-6-10-5-2-3-7-11(10)12/h2-3,5,7-8H,4,6H2,1H3,(H,13,14)
InChIKeyGGEKWMRJFDEYPF-UHFFFAOYSA-N
MW187.24 g/mol
LogP2.11
Rot. Bonds1

About N-(3,4-dihydronaphthalen-1-yl)acetamide

N-(3,4-dihydronaphthalen-1-yl)acetamide (PubChem CID 10176439) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is N-(3,4-dihydronaphthalen-1-yl)acetamide.

Molecular Properties

Compound NameN-(3,4-dihydronaphthalen-1-yl)acetamide
PubChem CID10176439
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC NameN-(3,4-dihydronaphthalen-1-yl)acetamide
SMILESCC(=O)NC1=CCCc2ccccc21
InChIInChI=1S/C12H13NO/c1-9(14)13-12-8-4-6-10-5-2-3-7-11(10)12/h2-3,5,7-8H,4,6H2,1H3,(H,13,14)
InChIKeyGGEKWMRJFDEYPF-UHFFFAOYSA-N
XLogP2.11
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydronaphthalen-1-yl)acetamide?
The IUPAC name of N-(3,4-dihydronaphthalen-1-yl)acetamide (CID 10176439) is N-(3,4-dihydronaphthalen-1-yl)acetamide.
What is the SMILES notation for N-(3,4-dihydronaphthalen-1-yl)acetamide?
The canonical SMILES for N-(3,4-dihydronaphthalen-1-yl)acetamide is CC(=O)NC1=CCCc2ccccc21.
What is the InChIKey of N-(3,4-dihydronaphthalen-1-yl)acetamide?
The InChIKey is GGEKWMRJFDEYPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-9(14)13-12-8-4-6-10-5-2-3-7-11(10)12/h2-3,5,7-8H,4,6H2,1H3,(H,13,14).
What are the key properties of N-(3,4-dihydronaphthalen-1-yl)acetamide?
N-(3,4-dihydronaphthalen-1-yl)acetamide has a molecular weight of 187.24 g/mol, XLogP of 2.11, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydronaphthalen-1-yl)acetamide is sourced from PubChem (CID 10176439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).